SMILES:
[N-]=[N+]=Nc1ccc2[nH]c3ccc(Br)cc3c2c1Molecular Processing
Molecular formula
C12H7BrN4
Molecular weight
287.12
Exact mass
285.9854
XLogP
5.03
TPSA
64.55
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
72.31
Supplementary Information
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